Compounds
ID | Spectrum Quality | Annotated Name |
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COMPOUND NPA012294
PROPERTIES
NPAID | NPA012294 |
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CLUSTER ID | 3593 |
NODE ID | 2704 |
NAME | 3-hydroxyhericenone F |
FORMULA | C35H54O7 |
MOLECULAR WEIGHT (Da) | 586.8100 |
ACCURATE MASS (Da) | 586.3870 |
ORIGIN ORGANISM TYPE | Fungus |
ORIGIN GENUS | Hericium |
ORIGIN SPECIES | erinaceum |
InChIKey | KSRGDCWFRBIFGR-FHPVIJFVSA-N |
InChI | InChI=1S/C35H54O7/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-33(38)41-25-27-21-31(40-5)29-22-32(42-34(29)30(27)24-36)35(4,39)23-28(37)20-26(2)3/h20-21,24,32,39H,6-19,22-23,25H2,1-5H3/t32-,35-/m1/s1 |
SMILES | CCCCCCCCCCCCCCCC(=O)OCC1=CC(OC)=C2C[C@H]([C@](C)(O)CC(=O)C=C(C)C)OC2=C1C=O |
ORIGINAL ISOLATION REFERENCE
CITATION | Ueda, Keiko; Tsujimori, Megumi; Kodani, Shinya; Chiba, Akiko; Kubo, Masakazu; Masuno, Kazuhiko; Sekiya, Atsushi; Nagai, Kaoru; Kawagishi, Hirokazu An endoplasmic reticulum (ER) stress-suppressive compound and its analogues from the mushroom Hericium erinaceum Bioorganic and Medicinal Chemistry 2008 16 (21) 9467-9470. | ||
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DOI | 10.1016/j.bmc.2008.09.044 | PMID | 18835171 |
REVISIONS
VERSION | SMILES | CITATION | ||
---|---|---|---|---|
Original Isolation | CCCCCCCCCCCCCCCC(=O)OCC1=CC(=C2C[C@@H]([C@](OC2=C1C=O)(C)CC(=O)C=C(C)C)O)OC | Ueda, Keiko; Tsujimori, Megumi; Kodani, Shinya; Chiba, Akiko; Kubo, Masakazu; Masuno, Kazuhiko; Sekiya, Atsushi; Nagai, Kaoru; Kawagishi, Hirokazu An endoplasmic reticulum (ER) stress-suppressive compound and its analogues from the mushroom Hericium erinaceum Bioorganic and Medicinal Chemistry 2008 16 (21) 9467-9470. DOI: 10.1016/j.bmc.2008.09.044 PMID: 18835171 | ||
2 | CCCCCCCCCCCCCCCC(=O)OCC1=CC(OC)=C2C[C@H]([C@](C)(O)CC(=O)C=C(C)C)OC2=C1C=O | Kobayashi, Shoji; Tamura, Tomoki; Koshishiba, Mizuho; Yasumoto, Takeshi; Shimizu, Satoshi; Kintaka, Tomoki; Nagai, Kaoru Total Synthesis, Structure Revision, and Neuroprotective Effect of Hericenones C-H and Their Derivatives. Journal of Organic Chemistry 2021 86 (3) 2602-2620. DOI: 10.1021/acs.joc.0c02681 PMID: 33492133 |